RefChem:561460
TL;DR: RefChem:561460 (CAS 52338-25-7) is a chemical compound with molecular formula C22H27N5O3 and molecular weight 409.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-cyano-6-hydroxy-4-methyl-2-oxo-1H-pyridin-3-yl)diazenyl]-N-(2-ethylhexyl)benzamide
Also Known As: 4-[[-3-yl]azo]-n- benzamide, 4-[[ -3-yl]azo]-N- benzamide, Benzamide, 4-((5-cyano-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-3-pyridinyl)azo)-N-(2-ethylhexyl)-, Benzamide, 4-(2-(5-cyano-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-N-(2-ethylhexyl)-, Benzamide, 4-[(5-cyano-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-3-pyridinyl)azo]-N-(2-ethylhexyl)-
| Molecular Formula | C22H27N5O3 |
|---|---|
| Molecular Weight | 409.21 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 409.2114 |
| Heavy Atoms | 30 |
| Complexity | 782.0 |
Chemical Identifiers
| CAS Number | 52338-25-7 |
|---|---|
| SMILES | CCCCC(CC)CNC(=O)C1=CC=C(C=C1)N=NC2=C(C(=C(NC2=O)O)C#N)C |
| InChIKey | WOGOSVOOLGCMFX-UHFFFAOYSA-N |
Product Overview
RefChem:561460 (CAS 52338-25-7), with molecular formula C22H27N5O3 and molecular weight 409.21 g/mol. IUPAC: 4-[(5-cyano-6-hydroxy-4-methyl-2-oxo-1H-pyridin-3-yl)diazenyl]-N-(2-ethylhexyl)benzamide.
Chemical Property Profile of RefChem:561460
Property Insights of RefChem:561460
The XLogP value of 4.4 indicates that RefChem:561460 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:561460. Following Lipinski's Rule of Five, RefChem:561460 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:561460?
The CAS number of RefChem:561460 is 52338-25-7.
What is the molecular formula of RefChem:561460?
The molecular formula of RefChem:561460 is C22H27N5O3.
What is the molecular weight of RefChem:561460?
The molecular weight of RefChem:561460 is 409.21 g/mol.
Where can I buy RefChem:561460?
You can request a quote for RefChem:561460 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:561460?
Yes, KEHONG BIO provides custom synthesis services for RefChem:561460 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.